Geometry & MOs

Info

ID:	184288
PubChem CID:	77140140
Reduced:	NO5C21H31 (1)
Stoich.:	AB5C21D31 (1)
Weight, g/mol:	507.186815
ΔH_f, kcal/mol:	-200.1
Dipole, Da:	4.62
IP(EA), eV:	-9.02(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[(4-methylphenyl)-(5-oxo-4,4-diphenylcyclopenten-1-yl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=O)C1=O)C(C)CCC=C(C)C)O)NC(C(C)C)C(=O)OC

DOS

IR

Vibrations